Estrutura e propriedades da difenil-4-amina sulfonato de sódio : um dopante de filmes condutores
| dc.date.accessioned | 2011-03-15T11:58:00Z | |
| dc.date.available | 2011-03-15T11:58:00Z | |
| dc.identifier.citation | PIRES, José Maria et al. Estrutura e propriedades da difenil-4-amina sulfonato de sódio: um dopante de filmes condutores. Quím. Nova, São Paulo, v. 29, n. 5, p. 977-982, set./out. 2006. Disponível em: <http://www.scielo.br/pdf/qn/v29n5/31060.pdf>. Acesso em: 14 mar. 2011. | por |
| dc.identifier.doi | 10.1590/S0100-40422006000500017 | |
| dc.identifier.issn | 0100-4042 | |
| dc.identifier.uri | http://repositorio.ufes.br/handle/10/612 | |
| dc.rights | open access | en |
| dc.title | Estrutura e propriedades da difenil-4-amina sulfonato de sódio : um dopante de filmes condutores | por |
| dc.type | article | en |
| dcterms.abstract | This work contains the theoretical simulation of the conformation of diphenyl-4-amine sodium sulphonate (DASNa) and correlates its geometry with conductivity, showing that the conductivity increases as the molecule becomes more planar. The solvent effect was also evaluated, using water and dimethylsulfoxide. Some properties, such as bond distance, vibration al frequency and effective charge were calculated. The utilization of diphenyl-4-amine sodium sulphonate (DASNa) as dopant of aniline was investigated in view of the HOMO-LUMO energy gap. | eng |
| dcterms.alternative | Structure and properties of diphenyl-4-amine sodium sulphonate : a dopant of conductive films | eng |
| dcterms.creator | Pires, José Maria | |
| dcterms.creator | Jorge, Francisco Elias | |
| dcterms.creator | Machado, Luiz Carlos | |
| dcterms.creator | Marins, Antonio Augusto Lopes | |
| dcterms.issued | 2006-09 | |
| dcterms.language | por | en |
| dcterms.subject | Polímeros | por |
| dcterms.subject | Molecular modeling | eng |
| dcterms.subject | Polymers | eng |
| dcterms.subject | Solvent effect | eng |